1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)heptan-3-ol

Systemtic Name: 1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)heptan-3-ol Openeye Name: 1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)heptan-3-ol CAS Name: 1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)-3-heptanol IUPAC Name: 1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)heptan-3-ol Traditional Name: 1-(4-chlorophenyl)-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)heptan-3-ol Formula: C18H26ClN3O MolecularWeight: 335.87154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CN1C=NC=N1)(C(C)(C)CC2=CC=C(C=C2)Cl)O

Isomeric SMILES

CCCCC(CN1C=NC=N1)(C(C)(C)CC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C18H26ClN3O/c1-4-5-10-18(23,12-22-14-20-13-21-22)17(2,3)11-15-6-8-16(19)9-7-15/h6-9,13-14,23H,4-5,10-12H2,1-3H3